Geometry & MOs

Info

ID:	55788
PubChem CID:	17396528
Reduced:	NO5H17C18 (1)
Stoich.:	AB5C17D18 (1)
Weight, g/mol:	342.157957
ΔH_f, kcal/mol:	-147.1
Dipole, Da:	3.36
IP(EA), eV:	-8.78(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(dimethylamino)-2-oxo-1-phenylethyl] 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CC(=O)C1=CC(=C(C=C1)NC(=O)C)OCC2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations